| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 17 | Yes |
Popular Name: 5-(1,4-diazepane-1-carbonyl)-1H-pyrimidine-2,4-dione 5-(1,4-diazepane-1-carbonyl)-1H-…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | -2.38 | -0.37 | -54.62 | 4 | 7 | 1 | 103 | 239.255 | 1 | ↓ |
| Hi High (pH 8-9.5) | -1.92 | -2.15 | -63.15 | 3 | 7 | 0 | 106 | 238.247 | 1 | ↓ |
| Mid Mid (pH 6-8) | -1.92 | -1.5 | -51.99 | 3 | 7 | 0 | 106 | 238.247 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
